SCHEMBL29333391

SCHEMBL29333391

C=CC(=O)N1CCOCC1c1cc(Cl)cc(-c2ncccn2)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 12/20 0.39
▸ HCRTR2 O43614 12/20 0.39
▸ CYP3A4 P08684 8/20 0.39
▸ CCNC P24863 1/20 0.37
▸ CDK8 P49336 1/20 0.37
▸ KRAS P01116 1/20 0.34
▸ BTK Q06187 4/20 0.34
▸ EGFR P00533 2/20 0.34
▸ BMX P51813 2/20 0.34
▸ ITK Q08881 2/20 0.34
▸ SRC P12931 1/20 0.33
▸ SCD5 Q86SK9 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31008584 1.00 HCRTR1 (0.39) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL29333580 0.91 CCNC (0.36) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL29333401 0.89 CCNC (0.35) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL29333520 0.89 CCNC (0.39) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL31008613 0.89 CCNC (0.35) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL29333510 0.89 CCNC (0.35) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL30855121 0.88 BTK (0.36) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL29333515 0.88 BTK (0.36) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL29333504 0.88 HCRTR1 (0.41) HCRTR1HCRTR2CYP3A4CCNCCDK8
SCHEMBL29333522 0.86 FGFR4 (0.36) HCRTR1HCRTR2CCNCCDK8BTK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 — — US disclosed
US-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240226114-A1 INHIBITORS AND USES THEREOF KEAP1, NQO1, NFE2L2 HCRTR1 3277/4885HCRTR2 3315/4885CYP3A4 3385/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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